COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL541317
Chemical Name: N-[(7S)-1,2,3-trimethoxy-10-({(2S)-1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-methyl-1-oxopentan-2-yl}amino)-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)[C@H]([C@@H](CC)C)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C

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Molecular Weight: 672.82
Empirical Formula: C38H48N4O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.378
Rotatable bonds: 6
H-donors: 2
H-acceptors: 7
PSA: 118
Number of rings: 5

     

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